4-ethoxy-N-[4-[[(2-methylsulfanylpyridin-3-yl)carbonylamino]carbamoyl]phenyl]benzenesulfonamide

Systemtic Name: 4-ethoxy-N-[4-[[(2-methylsulfanylpyridin-3-yl)carbonylamino]carbamoyl]phenyl]benzenesulfonamide Openeye Name: 4-ethoxy-N-[4-[[(2-methylsulfanylpyridine-3-carbonyl)amino]carbamoyl]phenyl]benzenesulfonamide CAS Name: 4-ethoxy-N-[4-[[[[2-(methylthio)-3-pyridinyl]-oxomethyl]hydrazo]-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: 4-ethoxy-N-[4-[[(2-methylsulfanylpyridine-3-carbonyl)amino]carbamoyl]phenyl]benzenesulfonamide Traditional Name: 4-ethoxy-N-[4-[[[2-(methylthio)nicotinoyl]amino]carbamoyl]phenyl]benzenesulfonamide Formula: C22H22N4O5S2 MolecularWeight: 486.56388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C22H22N4O5S2/c1-3-31-17-10-12-18(13-11-17)33(29,30)26-16-8-6-15(7-9-16)20(27)24-25-21(28)19-5-4-14-23-22(19)32-2/h4-14,26H,3H2,1-2H3,(H,24,27)(H,25,28)